6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one

C19H13N3O2 — CID 134805586

IUPAC6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one
SMILESO=c1c2nc(-c3cccc(O)c3)ccc2ncn1-c1ccccc1
InChIInChI=1S/C19H13N3O2/c23-15-8-4-5-13(11-15)16-9-10-17-18(21-16)19(24)22(12-20-17)14-6-2-1-3-7-14/h1-12,23H
InChIKeyWILIOGOPRWQFNJ-UHFFFAOYSA-N
MW315.33 g/mol
LogP3.15
Rot. Bonds2

About 6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one

6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one (PubChem CID 134805586) has the molecular formula C19H13N3O2 and a molecular weight of 315.33 g/mol. Its IUPAC name is 6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one.

Molecular Properties

Compound Name6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one
PubChem CID134805586
Molecular FormulaC19H13N3O2
Molecular Weight315.33 g/mol
Exact Mass315.10
IUPAC Name6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one
SMILESO=c1c2nc(-c3cccc(O)c3)ccc2ncn1-c1ccccc1
InChIInChI=1S/C19H13N3O2/c23-15-8-4-5-13(11-15)16-9-10-17-18(21-16)19(24)22(12-20-17)14-6-2-1-3-7-14/h1-12,23H
InChIKeyWILIOGOPRWQFNJ-UHFFFAOYSA-N
XLogP3.15
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.33
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Piperazine, 4-benzoyl-1-[1,2-dioxo-2-(6-hydroxy-2-quinolinyl)ethyl]-2-methyl-
CID 5280292
3-(2,4-Difluorophenyl)-6-(3-methoxyphenyl)pyrido[3,2-d]pyrimidin-4-one
CID 134806260
3-(2,4-Difluorophenyl)-6-(3,4-dimethoxyphenyl)pyrido[3,2-d]pyrimidin-4-one
CID 134808633
1-Benzyl-6-(4-fluoro-2-methoxyphenyl)pyrido[3,2-d]pyrimidin-4-one
CID 134810844
7-Hydroxy-3,11,21-triazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,13,15,17,19-nonaen-10-one
CID 135409754
6-(3-Fluoro-4-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one
CID 137279418
6-(3-Fluoro-4-hydroxyphenyl)-3-(pyridin-2-ylmethyl)pyrido[3,2-d]pyrimidin-4-one
CID 137279420
6-(3-Hydroxyphenyl)-3-methylpyrido[3,2-d]pyrimidin-4-one
CID 134805941
3-Cyclopropyl-6-(3-hydroxyphenyl)pyrido[3,2-d]pyrimidin-4-one
CID 134810923
3-(2,4-Difluorophenyl)-6-(2-methoxyphenyl)pyrido[3,2-d]pyrimidin-4-one
CID 134806611
3-(2,4-Difluorophenyl)-6-(2,3-dimethoxyphenyl)pyrido[3,2-d]pyrimidin-4-one
CID 134808698
3-(2,4-Difluorophenyl)-6-(2,5-dimethoxyphenyl)pyrido[3,2-d]pyrimidin-4-one
CID 134808976

Frequently Asked Questions

What is the IUPAC name of 6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one?
The IUPAC name of 6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one (CID 134805586) is 6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one.
What is the SMILES notation for 6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one?
The canonical SMILES for 6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one is O=c1c2nc(-c3cccc(O)c3)ccc2ncn1-c1ccccc1.
What is the InChIKey of 6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one?
The InChIKey is WILIOGOPRWQFNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3O2/c23-15-8-4-5-13(11-15)16-9-10-17-18(21-16)19(24)22(12-20-17)14-6-2-1-3-7-14/h1-12,23H.
What are the key properties of 6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one?
6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one has a molecular weight of 315.33 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-hydroxyphenyl)-3-phenylpyrido[3,2-d]pyrimidin-4-one is sourced from PubChem (CID 134805586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).